Evaluate the energy for the two MOs generated by combining two H1s Mos. Use the equation a + E = (equation below) and ca
Posted: Tue May 17, 2022 8:10 am
- Evaluate The Energy For The Two Mos Generated By Combining Two H1s Mos Use The Equation A E Equation Below And Ca 1 (29.74 KiB) Viewed 77 times
Evaluate the energy for the two MOs generated by combining two H1s Mos. Use the equation a + E = (equation below) and carry out the calculation for the following S values to mimic the 1+S effect of decreasing the atomic separation in the molecule. Use the parameters aa = 0g = -13.7 eV and B =-1.755, a • Ag. Explain the trend you see in the results. a) S = 0.15, 0.30, 0.45 b) S = 0.20, 0.40, 0.60 c) S = 0.10, 0.25, 0.50 d) S = 0.28, 0.56, 0.84 e) S = 0.33, 0.66, 0.99 e) S = 0.13, 0.26, 0.39 Equation: E. a+B 1+S E = a-B 1-S